Vitas-M small molecule compound
4-[(4-benzylpiperidinium-1-yl)methyl]-2-oxo-2H-chromen-6-olate
Catalog ID
STK597909
SMILES [O-]c1ccc2c(c1)c(C[NH+]1CCC(CC1)Cc1ccccc1)cc(=O)o2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H23NO3 MW 349.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO3/c24-19-6-7-21-20(14-19)18(13-22(25)26-21)15-23-10-8-17(9-11-23)12-16-4-2-1-3-5-16/h1-7,13-14,17,24H,8-12,15H2InChIKey
SGWRQAYAKUJHOL-UHFFFAOYSA-NSynonyms
899391-59-4(O)c1ccc2c(c1)c(C(NH+)1CCC(CC1)Cc1ccccc1)cc(=O)o2
4((4BENZYLPIPERIDIN1YL)METHYL)6HYDROXYCHROMEN2ONE
4((4benzylpiperidinium1yl)methyl)2oxo2Hchromen6olate
6HYDROXY4((4BENZYLPIPERIDYL)METHYL)CHROMEN2ONE
C1CN(CCC1CC2=CC=CC=C2)CC3=CC(=O)OC4=C3C=C(C=C4)O
InChI=1SC22H23NO3c2419672120(1419)18(1322(25)2621)152310817(91123)12164213516h1713141724H81215H2
MFCD06609858
ZINC000002346814
ZINC2346814
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